6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0446 |
| Compound Name: | 6-chloro-7-[(2,5-dimethylphenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 328.79 |
| Molecular Formula: | C19 H17 Cl O3 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.486 |
| logD: | 5.486 |
| logSw: | -5.9737 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9599 |
| InChI Key: | XSIKCJYFMCSZPC-UHFFFAOYSA-N |